Hi,
I made a PR earlier this week for the static and regular versions of
5.0.2, there the build seems to pass cleanly for myself and others:
https://github.com/easybuilders/easybuild-easyconfigs/pull/14522
Are you sure you're using the current version of the easyblock, in my
logs it has additional env-vars:
== 2021-12-10 13:32:10,286 easyblock.py:3172 INFO Using customised
sanity check commands: ['env OMPI_MCA_hwloc_base_use_hwthreads_as_cpus=1
$EBROOTORCA/bin/orca /eb/tmp/eb
-build/ORCA/5.0.2/gompi-2021a/eb_test_hf_water.inp', "env
OMPI_MCA_hwloc_base_use_hwthreads_as_cpus=1 $EBROOTORCA/bin/orca
/eb/tmp/eb-build/ORCA/5.0.2/gompi-2021a/eb_test_
hf_water.inp | grep -c 'FINAL SINGLE POINT ENERGY[ \t]*-75.95934031'"]
It looks like you may be capturing some diagnostic output header in your
sanity check, you might see the untruncated output earlier in the log.
// Lars
On 2021-12-09 14:51, Loris Bennett wrote:
Hi,
I took the existing
ORCA-5.0.1-gompi-2021a.eb
and changed the version to 5.0.2 and updated the checksums.
However the sanity check fails:
== 2021-12-09 14:41:39,976 easyblock.py:3915 WARNING build failed (first 300
chars): Sanity check failed: sanity check command $EBROOTORCA/bin/orca
/trinity/shared/easybuild/build/ORCA/5.0.2/gompi-2021a/eb_test_hf_water.inp |
grep -c 'FI\
NAL SINGLE POINT ENERGY[ ]*-75.95934031' exited with code 1 (output:
--------------------------------------------------------------------------
The
It looks like the formatting of the output has changed and this is
causing the test to fail.
I assume the easyblock for ORCA needs fixing, or is there some other
solution?
Cheers,
Loris
